3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
Chemical Structure Depiction of
3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
Compound characteristics
| Compound ID: | 8020-8637 |
| Compound Name: | 3-(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-3-(4-hydroxy-2-oxo-2H-1-benzopyran-3-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide |
| Molecular Weight: | 556.57 |
| Molecular Formula: | C31 H28 N2 O8 |
| Smiles: | COc1cc(C(CC(NCCc2c[nH]c3ccccc23)=O)C2=C(c3ccccc3OC2=O)O)c(c2c1OCO2)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.041 |
| logD: | 0.5219 |
| logSw: | -3.412 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 101.703 |
| InChI Key: | KGSCRJMFFDLKGQ-FQEVSTJZSA-N |